A1AFE
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C22 | C23 | doub | 1.38Å | 1.40Å | Aromatic |
| C22 | C21 | sing | 1.38Å | 1.40Å | Aromatic |
| C23 | C24 | sing | 1.37Å | 1.39Å | Aromatic |
| C21 | C20 | doub | 1.40Å | 1.41Å | Aromatic |
| C24 | C25 | doub | 1.41Å | 1.42Å | Aromatic |
| O19 | S17 | doub | 1.42Å | 1.46Å | |
| C20 | C25 | sing | 1.38Å | 1.38Å | Aromatic |
| C20 | S17 | sing | 1.75Å | 1.82Å | |
| C25 | C09 | sing | 1.47Å | 1.55Å | |
| C12 | C11 | doub | 1.38Å | 1.39Å | Aromatic |
| C12 | C13 | sing | 1.38Å | 1.40Å | Aromatic |
| C11 | C10 | sing | 1.40Å | 1.42Å | Aromatic |
| C13 | C14 | doub | 1.38Å | 1.39Å | Aromatic |
| S17 | O18 | doub | 1.42Å | 1.46Å | |
| S17 | C16 | sing | 1.79Å | 1.81Å | |
| C10 | C09 | sing | 1.47Å | 1.55Å | |
| C10 | C15 | doub | 1.37Å | 1.37Å | Aromatic |
| C14 | C15 | sing | 1.39Å | 1.42Å | Aromatic |
| C09 | C06 | doub | 1.34Å | 1.32Å | |
| C15 | C16 | sing | 1.50Å | 1.54Å | |
| C06 | C07 | sing | 1.51Å | 1.51Å | |
| C06 | C05 | sing | 1.51Å | 1.50Å | |
| C07 | C08 | sing | 1.53Å | 1.53Å | |
| C05 | C04 | sing | 1.53Å | 1.51Å | |
| C08 | N03 | sing | 1.47Å | 1.48Å | |
| C04 | N03 | sing | 1.47Å | 1.47Å | |
| N03 | C02 | sing | 1.35Å | 1.46Å | |
| C34 | N33 | doub | 1.32Å | 1.33Å | Aromatic |
| C34 | C26 | sing | 1.39Å | 1.38Å | Aromatic |
| C02 | C26 | sing | 1.47Å | 1.53Å | |
| C02 | O01 | doub | 1.22Å | 1.18Å | |
| N33 | C32 | sing | 1.32Å | 1.32Å | Aromatic |
| C26 | C27 | doub | 1.41Å | 1.42Å | Aromatic |
| C32 | C31 | doub | 1.39Å | 1.42Å | Aromatic |
| C27 | C31 | sing | 1.41Å | 1.36Å | Aromatic |
| C27 | N28 | sing | 1.37Å | 1.38Å | Aromatic |
| C31 | C30 | sing | 1.46Å | 1.41Å | Aromatic |
| N28 | C29 | sing | 1.37Å | 1.34Å | Aromatic |
| C30 | C29 | doub | 1.34Å | 1.39Å | Aromatic |
| C04 | H1 | sing | 1.09Å | 1.10Å | |
| C04 | H2 | sing | 1.09Å | 1.10Å | |
| C05 | H3 | sing | 1.09Å | 1.10Å | |
| C05 | H4 | sing | 1.09Å | 1.10Å | |
| C07 | H5 | sing | 1.09Å | 1.10Å | |
| C07 | H6 | sing | 1.09Å | 1.10Å | |
| C08 | H7 | sing | 1.09Å | 1.10Å | |
| C08 | H8 | sing | 1.09Å | 1.10Å | |
| C11 | H9 | sing | 1.08Å | 1.08Å | |
| C12 | H10 | sing | 1.08Å | 1.08Å | |
| C13 | H11 | sing | 1.08Å | 1.08Å | |
| C14 | H12 | sing | 1.08Å | 1.08Å | |
| C16 | H13 | sing | 1.09Å | 1.10Å | |
| C16 | H14 | sing | 1.09Å | 1.10Å | |
| C21 | H15 | sing | 1.08Å | 1.08Å | |
| C22 | H16 | sing | 1.08Å | 1.08Å | |
| C23 | H17 | sing | 1.08Å | 1.08Å | |
| C24 | H18 | sing | 1.08Å | 1.08Å | |
| C29 | H19 | sing | 1.08Å | 1.08Å | |
| C30 | H20 | sing | 1.08Å | 1.08Å | |
| C32 | H21 | sing | 1.08Å | 1.08Å | |
| C34 | H22 | sing | 1.08Å | 1.08Å | |
| N28 | H23 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C23 | C22 | C21 | 120.0° | 119.8° |
| C22 | C23 | C24 | 120.2° | 119.3° |
| C23 | C22 | H16 | 120.0° | 120.1° |
| C22 | C23 | H17 | 119.9° | 120.3° |
| C22 | C21 | C20 | 119.8° | 121.8° |
| C22 | C21 | H15 | 120.1° | 119.0° |
| C21 | C22 | H16 | 120.0° | 120.1° |
| C23 | C24 | C25 | 119.7° | 121.1° |
| C24 | C23 | H17 | 119.9° | 120.4° |
| C23 | C24 | H18 | 120.1° | 119.5° |
| C21 | C20 | C25 | 120.3° | 118.2° |
| C21 | C20 | S17 | 118.2° | 115.0° |
| C20 | C21 | H15 | 120.1° | 119.1° |
| C24 | C25 | C20 | 120.1° | 119.7° |
| C24 | C25 | C09 | 118.6° | 115.8° |
| C25 | C24 | H18 | 120.2° | 119.4° |
| O19 | S17 | C20 | 105.5° | 103.6° |
| O19 | S17 | O18 | 111.1° | 120.4° |
| O19 | S17 | C16 | 107.3° | 109.9° |
| C25 | C20 | S17 | 121.6° | 126.8° |
| C20 | C25 | C09 | 121.3° | 124.4° |
| C20 | S17 | O18 | 105.5° | 103.6° |
| C20 | S17 | C16 | 120.4° | 108.6° |
| C25 | C09 | C10 | 119.0° | 124.9° |
| C25 | C09 | C06 | 122.2° | 117.5° |
| C11 | C12 | C13 | 120.8° | 120.0° |
| C12 | C11 | C10 | 118.5° | 119.2° |
| C12 | C11 | H9 | 120.8° | 120.4° |
| C11 | C12 | H10 | 119.6° | 120.0° |
| C12 | C13 | C14 | 120.3° | 120.5° |
| C13 | C12 | H10 | 119.6° | 120.0° |
| C12 | C13 | H11 | 119.8° | 119.8° |
| C11 | C10 | C09 | 119.2° | 120.8° |
| C11 | C10 | C15 | 121.0° | 120.8° |
| C10 | C11 | H9 | 120.8° | 120.4° |
| C13 | C14 | C15 | 119.1° | 119.7° |
| C14 | C13 | H11 | 119.8° | 119.7° |
| C13 | C14 | H12 | 120.5° | 120.2° |
| O18 | S17 | C16 | 107.1° | 109.9° |
| S17 | C16 | C15 | 113.9° | 112.5° |
| S17 | C16 | H13 | 108.3° | 108.9° |
| S17 | C16 | H14 | 108.4° | 108.8° |
| C09 | C10 | C15 | 119.8° | 118.3° |
| C10 | C09 | C06 | 118.8° | 117.5° |
| C10 | C15 | C14 | 120.3° | 119.8° |
| C10 | C15 | C16 | 121.0° | 120.5° |
| C14 | C15 | C16 | 118.8° | 119.6° |
| C15 | C14 | H12 | 120.4° | 120.1° |
| C09 | C06 | C07 | 127.5° | 120.8° |
| C09 | C06 | C05 | 122.2° | 120.8° |
| C15 | C16 | H13 | 108.3° | 108.9° |
| C15 | C16 | H14 | 108.3° | 108.9° |
| C07 | C06 | C05 | 110.3° | 118.4° |
| C06 | C07 | C08 | 109.0° | 108.4° |
| C06 | C07 | H5 | 109.6° | 109.6° |
| C06 | C07 | H6 | 109.6° | 109.6° |
| C06 | C05 | C04 | 115.2° | 108.4° |
| C06 | C05 | H3 | 108.0° | 109.7° |
| C06 | C05 | H4 | 108.0° | 109.7° |
| C07 | C08 | N03 | 107.9° | 108.8° |
| C08 | C07 | H5 | 109.6° | 109.7° |
| C08 | C07 | H6 | 109.6° | 109.7° |
| C07 | C08 | H7 | 109.9° | 109.6° |
| C07 | C08 | H8 | 109.9° | 109.6° |
| C05 | C04 | N03 | 113.6° | 108.8° |
| C05 | C04 | H1 | 108.5° | 109.6° |
| C05 | C04 | H2 | 108.4° | 109.8° |
| C04 | C05 | H3 | 108.0° | 109.7° |
| C04 | C05 | H4 | 108.0° | 109.7° |
| C08 | N03 | C04 | 113.2° | 119.2° |
| C08 | N03 | C02 | 125.6° | 120.4° |
| N03 | C08 | H7 | 109.9° | 109.6° |
| N03 | C08 | H8 | 109.8° | 109.6° |
| C04 | N03 | C02 | 121.2° | 120.4° |
| N03 | C04 | H1 | 108.4° | 109.6° |
| N03 | C04 | H2 | 108.4° | 109.6° |
| N03 | C02 | C26 | 119.9° | 120.0° |
| N03 | C02 | O01 | 119.2° | 120.0° |
| N33 | C34 | C26 | 118.7° | 121.3° |
| C34 | N33 | C32 | 122.9° | 122.5° |
| N33 | C34 | H22 | 120.7° | 119.3° |
| C34 | C26 | C02 | 122.5° | 120.7° |
| C34 | C26 | C27 | 120.7° | 118.5° |
| C26 | C34 | H22 | 120.6° | 119.4° |
| C26 | C02 | O01 | 120.9° | 120.0° |
| C02 | C26 | C27 | 116.8° | 120.8° |
| N33 | C32 | C31 | 121.0° | 120.5° |
| N33 | C32 | H21 | 119.5° | 119.7° |
| C26 | C27 | C31 | 118.3° | 118.0° |
| C26 | C27 | N28 | 132.7° | 134.6° |
| C32 | C31 | C27 | 118.3° | 119.3° |
| C32 | C31 | C30 | 135.6° | 134.8° |
| C31 | C32 | H21 | 119.5° | 119.8° |
| C31 | C27 | N28 | 109.0° | 107.4° |
| C27 | C31 | C30 | 106.1° | 105.9° |
| C27 | N28 | C29 | 109.2° | 110.0° |
| C27 | N28 | H23 | 125.4° | 125.0° |
| C31 | C30 | C29 | 107.8° | 106.8° |
| C31 | C30 | H20 | 126.1° | 126.6° |
| N28 | C29 | C30 | 107.9° | 109.9° |
| N28 | C29 | H19 | 126.0° | 125.1° |
| C29 | N28 | H23 | 125.4° | 125.0° |
| C30 | C29 | H19 | 126.1° | 125.1° |
| C29 | C30 | H20 | 126.1° | 126.5° |
| H1 | C04 | H2 | 109.4° | 109.5° |
| H3 | C05 | H4 | 109.5° | 109.6° |
| H5 | C07 | H6 | 109.5° | 109.7° |
| H7 | C08 | H8 | 109.5° | 109.7° |
| H13 | C16 | H14 | 109.5° | 108.9° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C23 | C22 | C21 | H16 | 180.0° | 179.9° |
| C22 | C23 | C24 | H17 | 180.0° | 180.0° |
| C23 | C22 | C21 | C20 | 0.1° | 0.0° |
| C22 | C23 | C24 | C25 | 0.8° | 0.1° |
| C23 | C22 | C21 | H15 | 179.9° | 180.0° |
| C22 | C23 | C24 | H18 | 179.2° | 180.0° |
| C21 | C22 | C23 | C24 | 0.1° | 0.3° |
| C22 | C21 | C20 | H15 | 180.0° | 180.0° |
| C22 | C21 | C20 | C25 | 0.4° | 0.6° |
| C22 | C21 | C20 | S17 | 180.0° | 179.2° |
| C21 | C22 | C23 | H17 | 179.9° | 179.7° |
| C23 | C24 | C25 | H18 | 180.0° | 180.0° |
| C23 | C24 | C25 | C20 | 1.4° | 0.6° |
| C23 | C24 | C25 | C09 | 179.4° | 178.2° |
| C24 | C23 | C22 | H16 | 179.9° | 179.7° |
| C21 | C20 | C25 | C24 | 1.2° | 0.9° |
| C21 | C20 | S17 | O19 | 50.0° | 51.3° |
| C21 | C20 | C25 | S17 | 179.6° | 179.7° |
| C21 | C20 | C25 | C09 | 179.2° | 177.9° |
| C21 | C20 | S17 | O18 | 67.7° | 75.1° |
| C21 | C20 | S17 | C16 | 171.3° | 168.1° |
| C20 | C21 | C22 | H16 | 179.9° | 179.9° |
| C24 | C25 | C20 | C09 | 178.0° | 178.7° |
| C24 | C25 | C20 | S17 | 179.3° | 178.8° |
| C24 | C25 | C09 | C10 | 115.3° | 132.8° |
| C24 | C25 | C09 | C06 | 65.4° | 47.5° |
| C25 | C24 | C23 | H17 | 179.2° | 180.0° |
| O19 | S17 | C20 | C25 | 130.4° | 128.4° |
| O19 | S17 | C20 | O18 | 117.7° | 126.5° |
| O19 | S17 | C20 | C16 | 121.3° | 116.7° |
| O19 | S17 | O18 | C16 | 116.8° | 129.2° |
| O19 | S17 | C16 | C15 | 78.6° | 179.1° |
| O19 | S17 | C16 | H13 | 42.1° | 60.2° |
| O19 | S17 | C16 | H14 | 160.8° | 58.3° |
| C25 | C20 | S17 | O18 | 111.9° | 105.2° |
| C25 | C20 | S17 | C16 | 9.2° | 11.7° |
| C20 | C25 | C09 | C10 | 62.7° | 46.0° |
| C20 | C25 | C09 | C06 | 116.5° | 133.7° |
| C25 | C20 | C21 | H15 | 179.6° | 179.4° |
| C20 | C25 | C24 | H18 | 178.7° | 179.4° |
| S17 | C20 | C25 | C09 | 1.2° | 2.4° |
| C20 | S17 | O18 | C16 | 129.3° | 115.8° |
| C20 | S17 | C16 | C15 | 41.8° | 66.5° |
| C20 | S17 | C16 | H13 | 162.4° | 172.8° |
| C20 | S17 | C16 | H14 | 78.9° | 54.3° |
| S17 | C20 | C21 | H15 | 0.0° | 0.9° |
| C25 | C09 | C10 | C11 | 99.5° | 109.1° |
| C25 | C09 | C10 | C06 | 179.3° | 179.7° |
| C25 | C09 | C10 | C15 | 81.2° | 71.2° |
| C25 | C09 | C06 | C07 | 0.9° | 172.5° |
| C25 | C09 | C06 | C05 | 179.1° | 7.5° |
| C09 | C25 | C24 | H18 | 0.6° | 1.7° |
| C11 | C12 | C13 | H10 | 180.0° | 179.9° |
| C12 | C11 | C10 | H9 | 180.0° | 179.9° |
| C11 | C12 | C13 | C14 | 0.3° | 0.5° |
| C12 | C11 | C10 | C09 | 179.6° | 179.0° |
| C12 | C11 | C10 | C15 | 0.3° | 0.7° |
| C11 | C12 | C13 | H11 | 179.7° | 179.5° |
| C13 | C12 | C11 | C10 | 0.1° | 0.2° |
| C12 | C13 | C14 | H11 | 180.0° | 180.0° |
| C12 | C13 | C14 | C15 | 0.1° | 0.1° |
| C13 | C12 | C11 | H9 | 179.9° | 179.9° |
| C12 | C13 | C14 | H12 | 179.9° | 179.9° |
| C11 | C10 | C09 | C15 | 179.3° | 179.7° |
| C11 | C10 | C15 | C14 | 0.4° | 1.3° |
| C11 | C10 | C09 | C06 | 81.3° | 71.2° |
| C11 | C10 | C15 | C16 | 180.0° | 177.1° |
| C10 | C11 | C12 | H10 | 179.9° | 179.9° |
| C13 | C14 | C15 | C10 | 0.2° | 1.0° |
| C13 | C14 | C15 | H12 | 180.0° | 180.0° |
| C13 | C14 | C15 | C16 | 179.8° | 177.4° |
| C14 | C13 | C12 | H10 | 179.7° | 179.6° |
| O18 | S17 | C16 | C15 | 162.1° | 46.2° |
| O18 | S17 | C16 | H13 | 77.3° | 74.5° |
| O18 | S17 | C16 | H14 | 41.4° | 166.9° |
| S17 | C16 | C15 | C10 | 59.3° | 70.1° |
| S17 | C16 | C15 | C14 | 120.3° | 108.3° |
| S17 | C16 | C15 | H13 | 120.6° | 120.7° |
| S17 | C16 | C15 | H14 | 120.7° | 120.7° |
| S17 | C16 | H13 | H14 | 118.0° | 118.5° |
| C09 | C10 | C15 | C14 | 179.7° | 178.4° |
| C09 | C10 | C15 | C16 | 0.7° | 3.2° |
| C10 | C09 | C06 | C07 | 178.3° | 7.8° |
| C10 | C09 | C06 | C05 | 1.6° | 172.2° |
| C09 | C10 | C11 | H9 | 0.5° | 1.2° |
| C10 | C15 | C14 | C16 | 179.6° | 178.4° |
| C15 | C10 | C09 | C06 | 98.0° | 108.5° |
| C15 | C10 | C11 | H9 | 179.8° | 179.2° |
| C10 | C15 | C14 | H12 | 179.8° | 179.0° |
| C10 | C15 | C16 | H13 | 179.9° | 169.1° |
| C10 | C15 | C16 | H14 | 61.4° | 50.6° |
| C15 | C14 | C13 | H11 | 179.9° | 179.9° |
| C14 | C15 | C16 | H13 | 0.3° | 12.4° |
| C14 | C15 | C16 | H14 | 119.0° | 131.0° |
| C09 | C06 | C07 | C05 | 180.0° | 180.0° |
| C09 | C06 | C07 | C08 | 121.9° | 127.0° |
| C09 | C06 | C05 | C04 | 133.0° | 127.0° |
| C09 | C06 | C05 | H3 | 106.1° | 7.3° |
| C09 | C06 | C05 | H4 | 12.2° | 113.2° |
| C09 | C06 | C07 | H5 | 1.9° | 7.2° |
| C09 | C06 | C07 | H6 | 118.2° | 113.2° |
| C16 | C15 | C14 | H12 | 0.2° | 2.6° |
| C15 | C16 | H13 | H14 | 117.9° | 118.6° |
| C06 | C07 | C08 | H5 | 119.9° | 119.7° |
| C06 | C07 | C08 | H6 | 119.9° | 119.7° |
| C07 | C06 | C05 | C04 | 46.9° | 53.0° |
| C06 | C07 | C08 | N03 | 64.6° | 49.4° |
| C07 | C06 | C05 | H3 | 73.9° | 172.7° |
| C07 | C06 | C05 | H4 | 167.8° | 66.8° |
| C06 | C07 | H5 | H6 | 120.2° | 120.4° |
| C06 | C07 | C08 | H7 | 55.1° | 70.4° |
| C06 | C07 | C08 | H8 | 175.6° | 169.2° |
| C05 | C06 | C07 | C08 | 58.1° | 52.9° |
| C06 | C05 | C04 | H3 | 120.8° | 119.7° |
| C06 | C05 | C04 | H4 | 120.8° | 119.8° |
| C06 | C05 | C04 | N03 | 41.7° | 49.5° |
| C06 | C05 | C04 | H1 | 162.3° | 169.2° |
| C06 | C05 | C04 | H2 | 78.9° | 70.5° |
| C06 | C05 | H3 | H4 | 117.4° | 120.6° |
| C05 | C06 | C07 | H5 | 178.0° | 172.7° |
| C05 | C06 | C07 | H6 | 61.8° | 66.8° |
| C07 | C08 | N03 | H7 | 119.8° | 119.8° |
| C07 | C08 | N03 | H8 | 119.7° | 119.8° |
| C07 | C08 | N03 | C04 | 59.9° | 57.6° |
| C07 | C08 | N03 | C02 | 118.6° | 122.4° |
| C08 | C07 | H5 | H6 | 120.2° | 120.6° |
| C07 | C08 | H7 | H8 | 120.7° | 120.4° |
| C05 | C04 | N03 | C08 | 48.5° | 57.6° |
| C05 | C04 | N03 | H1 | 120.7° | 119.8° |
| C05 | C04 | N03 | H2 | 120.6° | 120.0° |
| C05 | C04 | N03 | C02 | 130.0° | 122.4° |
| C05 | C04 | H1 | H2 | 118.1° | 120.4° |
| C04 | C05 | H3 | H4 | 117.4° | 120.5° |
| C08 | N03 | C04 | C02 | 178.5° | 180.0° |
| C08 | N03 | C02 | C26 | 3.2° | 175.1° |
| C08 | N03 | C02 | O01 | 179.0° | 5.3° |
| C08 | N03 | C04 | H1 | 169.1° | 177.4° |
| C08 | N03 | C04 | H2 | 72.1° | 62.4° |
| N03 | C08 | C07 | H5 | 175.4° | 169.1° |
| N03 | C08 | C07 | H6 | 55.3° | 70.3° |
| N03 | C08 | H7 | H8 | 120.7° | 120.3° |
| C04 | N03 | C02 | C26 | 178.5° | 4.9° |
| C04 | N03 | C02 | O01 | 0.6° | 174.8° |
| N03 | C04 | H1 | H2 | 118.1° | 120.3° |
| N03 | C04 | C05 | H3 | 79.1° | 169.2° |
| N03 | C04 | C05 | H4 | 162.5° | 70.3° |
| C04 | N03 | C08 | H7 | 59.9° | 62.1° |
| C04 | N03 | C08 | H8 | 179.6° | 177.4° |
| N03 | C02 | C26 | C34 | 97.0° | 53.8° |
| N03 | C02 | C26 | O01 | 177.8° | 179.6° |
| N03 | C02 | C26 | C27 | 83.2° | 125.9° |
| C02 | N03 | C04 | H1 | 9.4° | 2.6° |
| C02 | N03 | C04 | H2 | 109.3° | 117.6° |
| C02 | N03 | C08 | H7 | 121.7° | 117.8° |
| C02 | N03 | C08 | H8 | 1.2° | 2.6° |
| N33 | C34 | C26 | H22 | 180.0° | 179.4° |
| N33 | C34 | C26 | C02 | 179.9° | 179.7° |
| N33 | C34 | C26 | C27 | 0.1° | 0.5° |
| C34 | N33 | C32 | C31 | 0.1° | 0.3° |
| C34 | N33 | C32 | H21 | 179.9° | 179.7° |
| C34 | C26 | C02 | C27 | 179.8° | 179.8° |
| C34 | C26 | C02 | O01 | 85.2° | 126.5° |
| C26 | C34 | N33 | C32 | 0.0° | 0.6° |
| C34 | C26 | C27 | C31 | 0.0° | 0.2° |
| C34 | C26 | C27 | N28 | 179.9° | 179.8° |
| C02 | C26 | C27 | C31 | 179.8° | 180.0° |
| C02 | C26 | C27 | N28 | 0.1° | 0.0° |
| C02 | C26 | C34 | H22 | 0.1° | 0.3° |
| O01 | C02 | C26 | C27 | 94.6° | 53.7° |
| N33 | C32 | C31 | H21 | 180.0° | 180.0° |
| N33 | C32 | C31 | C27 | 0.2° | 0.0° |
| N33 | C32 | C31 | C30 | 180.0° | 180.0° |
| C32 | N33 | C34 | H22 | 180.0° | 180.0° |
| C26 | C27 | C31 | C32 | 0.1° | 0.0° |
| C26 | C27 | C31 | N28 | 180.0° | 180.0° |
| C26 | C27 | C31 | C30 | 180.0° | 180.0° |
| C26 | C27 | N28 | C29 | 180.0° | 180.0° |
| C27 | C26 | C34 | H22 | 179.9° | 179.9° |
| C26 | C27 | N28 | H23 | 0.0° | 0.0° |
| C32 | C31 | C27 | C30 | 179.9° | 180.0° |
| C32 | C31 | C27 | N28 | 179.9° | 180.0° |
| C32 | C31 | C30 | C29 | 179.9° | 180.0° |
| C32 | C31 | C30 | H20 | 0.1° | 0.0° |
| C31 | C27 | N28 | C29 | 0.0° | 0.0° |
| C27 | C31 | C30 | C29 | 0.1° | 0.0° |
| C27 | C31 | C30 | H20 | 179.9° | 180.0° |
| C27 | C31 | C32 | H21 | 179.8° | 180.0° |
| C31 | C27 | N28 | H23 | 180.0° | 180.0° |
| N28 | C27 | C31 | C30 | 0.1° | 0.0° |
| C27 | N28 | C29 | H23 | 180.0° | 179.9° |
| C27 | N28 | C29 | C30 | 0.0° | 0.0° |
| C27 | N28 | C29 | H19 | 180.0° | 180.0° |
| C31 | C30 | C29 | N28 | 0.0° | 0.0° |
| C31 | C30 | C29 | H20 | 180.0° | 180.0° |
| C31 | C30 | C29 | H19 | 180.0° | 180.0° |
| C30 | C31 | C32 | H21 | 0.0° | 0.0° |
| N28 | C29 | C30 | H19 | 180.0° | 180.0° |
| N28 | C29 | C30 | H20 | 180.0° | 180.0° |
| C30 | C29 | N28 | H23 | 180.0° | 180.0° |
| H1 | C04 | C05 | H3 | 41.5° | 71.0° |
| H1 | C04 | C05 | H4 | 76.8° | 49.4° |
| H2 | C04 | C05 | H3 | 160.3° | 49.3° |
| H2 | C04 | C05 | H4 | 41.9° | 169.7° |
| H5 | C07 | C08 | H7 | 64.8° | 49.4° |
| H5 | C07 | C08 | H8 | 55.7° | 71.1° |
| H6 | C07 | C08 | H7 | 175.0° | 169.9° |
| H6 | C07 | C08 | H8 | 64.5° | 49.5° |
| H9 | C11 | C12 | H10 | 0.1° | 0.0° |
| H10 | C12 | C13 | H11 | 0.3° | 0.4° |
| H11 | C13 | C14 | H12 | 0.1° | 0.1° |
| H15 | C21 | C22 | H16 | 0.1° | 0.0° |
| H16 | C22 | C23 | H17 | 0.1° | 0.4° |
| H17 | C23 | C24 | H18 | 0.8° | 0.0° |
| H19 | C29 | C30 | H20 | 0.0° | 0.0° |
| H19 | C29 | N28 | H23 | 0.0° | 0.0° |
